Real-Time Extension of TAO-DFT

Thermally assisted occupation density functional theory (TAO-DFT) has been an efficient electronic structure method for studying the ground-state properties of large electronic systems with multi-reference character over the past few years. To explore the time-dependent (TD) properties of electronic...

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Detalles Bibliográficos
Autores principales: Tsai, Hung-Yi, Chai, Jeng-Da
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10647330/
https://www.ncbi.nlm.nih.gov/pubmed/37959667
http://dx.doi.org/10.3390/molecules28217247

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10647330/
https://www.ncbi.nlm.nih.gov/pubmed/37959667
http://dx.doi.org/10.3390/molecules28217247

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